Re: rmsd calculation in namd

From: Giacomo Fiorin (giacomo.fiorin_at_gmail.com)
Date: Fri Sep 07 2012 - 15:36:59 CDT

Hi Guanglei, very simple answer: unfortunately not yet, sorry, but it will
be possible in the not too fare future.

Giacomo

On Fri, Sep 7, 2012 at 3:57 PM, Guanglei Cui
<amber.mail.archive_at_gmail.com>wrote:

> Hi everyone,
>
> can someone let me know if it's possible to define the rmsd collective
> variable such that the overlay and rmsd calculation are done on
> separate sets of atoms? Thanks very much.
>
> Regards,
> Guanglei
>
>

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